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The discovery of new energetic materials remains a pressing challenge hindered by limited availability of high-quality data. To address this, we have developed generative molecular language models that have been pretrained on extensive…

Deep latent variable models (LVM) such as variational auto-encoder (VAE) have recently played an important role in text generation. One key factor is the exploitation of smooth latent structures to guide the generation. However, the…

Machine Learning · Computer Science 2019-12-02 Le Fang , Chunyuan Li , Jianfeng Gao , Wen Dong , Changyou Chen

Real-world data generation often involves complex inter-dependencies among instances, violating the IID-data hypothesis of standard learning paradigms and posing a challenge for uncovering the geometric structures for learning desired…

Machine Learning · Computer Science 2023-05-30 Qitian Wu , Chenxiao Yang , Wentao Zhao , Yixuan He , David Wipf , Junchi Yan

With the advent of score-matching techniques for model training and Langevin dynamics for sample generation, energy-based models (EBMs) have gained renewed interest as generative models. Recent EBMs usually use neural networks to define…

Machine Learning · Computer Science 2025-05-05 Yukun Li , Li-Ping Liu

Text-to-image diffusion models have demonstrated remarkable effectiveness in rapid and high-fidelity personalization, even when provided with only a few user images. However, the effectiveness of personalization techniques has lead to…

Computer Vision and Pattern Recognition · Computer Science 2025-10-06 Naresh Kumar Devulapally , Shruti Agarwal , Tejas Gokhale , Vishnu Suresh Lokhande

Deep learning models tend to forget their earlier knowledge while incrementally learning new tasks. This behavior emerges because the parameter updates optimized for the new tasks may not align well with the updates suitable for older…

Computer Vision and Pattern Recognition · Computer Science 2022-03-29 K J Joseph , Salman Khan , Fahad Shahbaz Khan , Rao Muhammad Anwer , Vineeth N Balasubramanian

Despite the significant recent progress in deep generative models, the underlying structure of their latent spaces is still poorly understood, thereby making the task of performing semantically meaningful latent traversals an open research…

Machine Learning · Computer Science 2023-07-04 Yue Song , T. Anderson Keller , Nicu Sebe , Max Welling

Deep neural networks (DNNs) are easily fooled by adversarial perturbations that are imperceptible to humans. Adversarial training, a process where adversarial examples are added to the training set, is the current state-of-the-art defense…

Machine Learning · Computer Science 2024-01-23 Siddharth Mansingh , Michal Kucer , Garrett Kenyon , Juston Moore , Michael Teti

For speech classification tasks, deep learning models often achieve high accuracy but exhibit shortcomings in calibration, manifesting as classifiers exhibiting overconfidence. The significance of calibration lies in its critical role in…

Audio and Speech Processing · Electrical Eng. & Systems 2024-06-27 Yaqian Hao , Chenguang Hu , Yingying Gao , Shilei Zhang , Junlan Feng

We introduce Diffusion Active Learning, a novel approach that combines generative diffusion modeling with data-driven sequential experimental design to adaptively acquire data for inverse problems. Although broadly applicable, we focus on…

Machine Learning · Computer Science 2025-04-07 Luis Barba , Johannes Kirschner , Tomas Aidukas , Manuel Guizar-Sicairos , Benjamín Béjar

The latent space of diffusion model mostly still remains unexplored, despite its great success and potential in the field of generative modeling. In fact, the latent space of existing diffusion models are entangled, with a distorted mapping…

Machine Learning · Computer Science 2024-07-17 Jaehoon Hahm , Junho Lee , Sunghyun Kim , Joonseok Lee

Diffusion models have shown promising capabilities in trajectory generation for planning in offline reinforcement learning (RL). However, conventional diffusion-based planning methods often fail to account for the fact that generating…

Artificial Intelligence · Computer Science 2026-02-25 Hanping Zhang , Yuhong Guo

By reinterpreting a robust discriminative classifier as Energy-based Model (EBM), we offer a new take on the dynamics of adversarial training (AT). Our analysis of the energy landscape during AT reveals that untargeted attacks generate…

Computer Vision and Pattern Recognition · Computer Science 2024-09-11 Mujtaba Hussain Mirza , Maria Rosaria Briglia , Senad Beadini , Iacopo Masi

The ability to accurately model random fields plays a critical role in science and engineering for problems involving uncertain, spatially-varying quantities such as heterogeneous material properties and turbulent flows. Deep generative…

We present our findings in the gap between theory and practice of using conditional energy-based models (EBM) as an implicit representation for behavior-cloned policies. We also clarify several subtle, and potentially confusing, details in…

Robotics · Computer Science 2022-07-14 Duy-Nguyen Ta , Eric Cousineau , Huihua Zhao , Siyuan Feng

This paper studies a curious phenomenon in learning energy-based model (EBM) using MCMC. In each learning iteration, we generate synthesized examples by running a non-convergent, non-mixing, and non-persistent short-run MCMC toward the…

Machine Learning · Statistics 2019-11-27 Erik Nijkamp , Mitch Hill , Song-Chun Zhu , Ying Nian Wu

The recent availability of large datasets in bio-medicine has inspired the development of representation learning methods for multiple healthcare applications. Despite advances in predictive performance, the clinical utility of such methods…

Signal Processing · Electrical Eng. & Systems 2022-10-18 Neeraj Wagh , Jionghao Wei , Samarth Rawal , Brent M. Berry , Yogatheesan Varatharajah

The recovery of training data from generative models ("model inversion") has been extensively studied for diffusion models in the data domain as a memorization/overfitting phenomenon. Latent diffusion models (LDMs), which operate on the…

Machine Learning · Computer Science 2026-03-26 Mingxing Rao , Bowen Qu , Daniel Moyer

Among likelihood-based approaches for deep generative modelling, variational autoencoders (VAEs) offer scalable amortized posterior inference and fast sampling. However, VAEs are also more and more outperformed by competing models such as…

Machine Learning · Computer Science 2021-07-01 Antoine Wehenkel , Gilles Louppe

This paper presents a novel theoretical framework for understanding how diffusion models can learn disentangled representations. Within this framework, we establish identifiability conditions for general disentangled latent variable models,…